SCHEMBL14669451

SCHEMBL14669451

C=C([C@H](Cc1cccc(C(=N)N)c1)NS(=O)(=O)c1cccc2ccccc12)N1CCC(C(=O)O)CC1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 14/20 0.71
PLAU P00749 8/20 0.71
PLG P00747 6/20 0.65
ST14 Q9Y5Y6 5/20 0.65
F2 P00734 4/20 0.65
HPN P05981 1/20 0.58
HGFAC Q04756 1/20 0.58
PLAT P00750 1/20 0.56

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14669448 0.92 F10 (0.70) F10PLAUPLGST14F2
SCHEMBL14669330 0.89 F10 (0.88) F10PLAUPLGST14F2
SCHEMBL14669329 0.81 F10 (0.87) F10PLAUPLGST14F2
SCHEMBL14669450 0.80 F10 (0.74) F10PLAUPLGST14F2
N-(Ethoxycarbonyl)Piperazine SCHEMBL7137671 0.77 PLAU (0.65) F10PLAUPLGST14F2
SCHEMBL14669460 0.77 PLG (0.84) F10PLAUPLGHPN
SCHEMBL14669328 0.77 F10 (0.70) F10PLAUPLGST14F2
SCHEMBL8202516 0.74 ST14 (0.90) F10PLAUPLGST14F2
SCHEMBL30583341 0.74 F10 (1.00) F10PLAUPLGST14F2
SCHEMBL18049396 0.73 ST14 (1.00) F10PLAUPLGST14F2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013014074-A1 USE OF TMPRSS2 INHIBITORS AS MEDICAMENTS PHILIPPS-UNIVERSITÄT MARBURG (DE) 2013-01-31 WO disclosed